SCHEMBL28979322

SCHEMBL28979322

CN1c2ccccc2N(Cc2ccccc2)C1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.42
MTNR1A P48039 5/20 0.41
EHMT2 Q96KQ7 1/20 0.41
CACNA1G O43497 2/20 0.39
CACNA1H O95180 2/20 0.39
CACNA1I Q9P0X4 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR5 Q9H228 1/20 0.39
AMPD2 Q01433 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28979084 0.83 CASP1 (0.37) BRD4MTNR1AMEN1POLBKMT2A
SCHEMBL28283868 0.82 MTNR1A (0.40) BRD4MTNR1AHDAC6MEN1POLB
SCHEMBL28283765 0.80 HDAC4 (0.43)
SCHEMBL28979077 0.78 GAA (0.38) BRD4MEN1POLBKMT2A
SCHEMBL28979065 0.78 CDC25A (0.44) MEN1POLBKMT2A
SCHEMBL28979096 0.77 CDC25A (0.46) MEN1POLBKMT2A
SCHEMBL28979082 0.77 CDC25A (0.46) MEN1POLBKMT2A
SCHEMBL28979323 0.77 CDC25A (0.46) MEN1POLBKMT2A
SCHEMBL28979310 0.77 CDC25A (0.46) MEN1POLBKMT2A
SCHEMBL28283751 0.77 CDC25A (0.46) MEN1POLBKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475765-B Preparation method of amide compound 广荣化学株式会社 2023-04-07 CN disclosed